| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 19 | Yes |
Popular Name: N-butyl-N-[[2-(propylaminomethyl)thiazol-4-yl]methyl]cyclopropanamine N-butyl-N-[[2-(propylaminomethyl…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.88 | 8.33 | -88.4 | 3 | 3 | 2 | 34 | 283.485 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.88 | 4.93 | -3.42 | 1 | 3 | 0 | 28 | 281.469 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.88 | 6.97 | -31.3 | 2 | 3 | 1 | 29 | 282.477 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
